2-[[4-(furan-2-ylmethyl)-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-(2-furylmethyl)-5-(1-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-furanylmethyl)-5-(1-naphthalenyloxymethyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2-furfuryl)-5-(1-naphthoxymethyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C20H16N3O4S- MolecularWeight: 394.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCC3=NN=C(N3CC4=CC=CO4)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCC3=NN=C(N3CC4=CC=CO4)SCC(=O)[O-]

InChI

InChI=1S/C20H17N3O4S/c24-19(25)13-28-20-22-21-18(23(20)11-15-7-4-10-26-15)12-27-17-9-3-6-14-5-1-2-8-16(14)17/h1-10H,11-13H2,(H,24,25)/p-1